{"1": { "calculator": "gpaw", "calculator_parameters": {}, "cell": {"array": {"__ndarray__": [[3, 3], "float64", [7.101815744159558, 1.1403526829983601e-17, 9.747790374771988e-18, 3.8397460062341667e-16, 6.352753807619109, 5.821422654641838e-08, 3.6693785711367676e-16, 5.231741245562399e-08, 6.006449053492018]]}, "__ase_objtype__": "cell"}, "ctime": 24.97545688508366, "energy": 297.9749151213597, "forces": {"__ndarray__": [[16, 3], "float64", [6.96898960664931e-19, 0.0073650530841750635, -0.004673655210809337, -6.96898960664931e-19, -0.007365143736589733, -0.004673717237284081, 2.613371102493491e-19, 0.0067631293420789135, -0.0026679202932599656, -6.96898960664931e-19, -0.006763127764992418, -0.0026678421206707513, 0.008948253660370257, -0.003763225883814431, 0.00038329007392163314, -0.008948253660370257, -0.003763225883814431, 0.00038329007392163314, -0.008948281563393522, 0.0037634129815708912, 0.00038304645445000855, 0.008948281563393522, 0.0037634129815708912, 0.00038304645445000855, 0.0, -0.002059977452251006, -0.0038615936550057584, 0.0, 0.0020599168655620766, -0.003861704908628787, 0.0, -0.008053910378180505, 0.0049253497580978465, 0.0, 0.008053773839881066, 0.004925332486061769, -0.004864439025971808, -0.0004661800851976173, 0.0026793934590510736, 0.004864439025971808, -0.0004661800851976173, 0.0026793934590510736, 0.004864447510380403, 0.0004661359678917442, 0.0026791906995876514, -0.004864447510380403, 0.0004661359678917442, 0.0026791906995876514]]}, "mtime": 24.97545688508366, "numbers": {"__ndarray__": [[16], "int64", [32, 32, 4, 4, 29, 29, 29, 29, 16, 16, 16, 16, 16, 16, 16, 16]]}, "pbc": {"__ndarray__": [[3], "bool", [true, true, true]]}, "positions": {"__ndarray__": [[16, 3], "float64", [3.5509078720797795, 0.9875095215010997, 2.986993523793928, 3.6245322442593233e-16, 5.365244315133112, -0.016230969169770168, 3.5509078720797813, 5.339754966688372, 6.0083631577876755, 2.6485554351438563e-16, 1.0129989018732886, 3.0051386128583304, 5.327410615065179, 4.259261085475377, 2.9262489113884067, 1.774405129094383, 4.259261085475377, 2.9262489113884063, 5.3253130096671715, 2.093492747380969, 5.929473483745056, 1.77650273449239, 2.093492747380969, 5.929473483745055, 3.5509078720797795, 0.9450432472197663, 0.7239188420200751, 5.894431607913701e-16, 5.407710565979413, 3.727143402222916, 3.5509078720797813, 5.290071188771463, 3.8876820070928155, 1.42510851146452e-16, 1.062682631829657, 0.8844574712110719, 5.250909702920664, 4.238763784375929, 0.6814509443761181, 1.850906041238903, 4.238763784375929, 0.6814509443761181, 5.401813913174829, 2.1139900284939936, 3.6846754988260653, 1.7000018309847387, 2.1139900284939936, 3.6846754988260653]]}, "stress": {"__ndarray__": [[6], "float64", [-7.937636565495311e-05, 0.00011378212828141785, 3.8712002600200055e-05, 6.243068761862891e-09, 4.860686267502854e-21, 0.0]]}, "unique_id": "e548511b64fbc7b7c298d0396eefd334", "user": "cmr"}, "ids": [1], "nextid": 2}